ATOM 13
1 C8x C 24.9504 -18.1451
2 C8x C 26.1879 -20.2396
3 C8x C 23.8113 -18.8598
4 C8x C 24.9789 -20.9543
5 C8y C 26.1736 -18.8350
6 C8y C 23.8253 -20.2642
7 C1b C 27.3829 -18.1203
8 C1b C 28.6064 -18.8105
9 C1a C 33.4717 -18.7609
10 C1b C 29.8156 -18.0958
11 C1b C 32.2482 -18.0710
12 C1b C 31.0390 -18.7856
13 O1a O 22.5461 -20.9788
BOND 13
1 1 3 2
2 1 5 1
3 2 4 1
4 2 5 2
5 3 6 1
6 4 6 2
7 5 7 1
8 6 13 1
9 7 8 1
10 8 10 1
11 9 11 1
12 10 12 1
13 11 12 1
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